2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]oxazol-5-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]-5-oxazolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]-1,3-oxazol-5-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-cyano-2-[(4-ethoxyphenoxy)methyl]oxazol-5-yl]amino]ethyl-dimethyl-ammonium Formula: C17H23N4O3+ MolecularWeight: 331.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=NC(=C(O2)NCC[NH+](C)C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=NC(=C(O2)NCC[NH+](C)C)C#N

InChI

InChI=1S/C17H22N4O3/c1-4-22-13-5-7-14(8-6-13)23-12-16-20-15(11-18)17(24-16)19-9-10-21(2)3/h5-8,19H,4,9-10,12H2,1-3H3/p+1